Formaldehyde → HCID 25230624, compound

HRID 2124581Notes

Reaction equation

[CH2:30]=[O:31].[CH3:32][OH:33].[Cl:1][c:2]1[cH:3][c:4](-[n:20]2[n:21][c:22]([C:28]#[N:29])[c:23](=[O:27])[nH:24][c:25]2=[O:26])[cH:5][c:6]([Cl:19])[c:7]1[O:8][c:9]1[n:10][nH:11][c:12](=[O:18])[c:13]([CH:15]([CH3:16])[CH3:17])[cH:14]1.[OH2:34]>>[Cl:1][c:2]1[cH:3][c:4](-[n:20]2[n:21][c:22]([C:28]#[N:29])[c:23](=[O:27])[nH:24][c:25]2=[O:26])[cH:5][c:6]([Cl:19])[c:7]1[O:8][c:9]1[n:10][n:11]([CH2:30][OH:31])[c:12](=[O:18])[c:13]([CH:15]([CH3:16])[CH3:17])[cH:14]1

Participants

Reactant 4

HCID 712Formaldehyde

HCID 887Methanol

HCID 962Water

HCID 159812372-{3,5-Dichloro-4-[(5-isopropyl-6-oxo-1,6-dihydro-3-pyridazinyl)oxy]phenyl}-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile

Product 1

HCID 25230624HCID 25230624, compound

Sources & evidence

ORD record: ord-dbda51a0f6bb4f5c994a6690cb1365d7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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